Eupacunoxin
[(3aS,4R,5Z,7S,9S,10Z,11aR)-9-acetyloxy-7-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate
Also Known As: EUPACUNOXIN|[(3aS,4R,5Z,7S,9S,10Z,11aR)-9-acetyloxy-7-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate|(2R,3R)-2,3-Dimethyl-2-oxiranecarboxylic acid [(3aS,4R,5Z,7S,9S,10Z,11aR)-9-acetoxy-2,3,3a,4,7,8,9,11a-octahydro-7-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl] ester
| Molecular Formula | C22H28O8 |
|---|---|
| Molecular Weight | 420.1784 g/mol |
| LogP | 1.7623 |
| Topological Polar Surface Area | 111.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.1784 |
| Monoisotopic Mass | 420.1784 |
| Heavy Atoms | 30 |
| Complexity | 840.0756 |
Chemical Identifiers
| CAS Number | 33853-88-2 |
|---|---|
| SMILES | C[C@@H]1[C@](O1)(C)C(=O)O[C@@H]2/C=C(\[C@H](C[C@@H](/C(=C\[C@@H]3[C@@H]2C(=C)C(=O)O3)/C)OC(=O)C)O)/C |
Product Overview
Eupacunoxin (CAS 33853-88-2), with molecular formula C22H28O8 and molecular weight 420.1784 g/mol. IUPAC: [(3aS,4R,5Z,7S,9S,10Z,11aR)-9-acetyloxy-7-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate.
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